Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:56:52 UTC
Update Date2025-03-21 22:02:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00477704
Frequency3.6
Structure
Chemical FormulaC4H8O2
Molecular Mass88.0524
SMILESCC1(O)COC1
InChI KeyDHDPUVPGALXWOL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxetanes
  • Substituents
  • oxacycle
  • tertiary alcohol
  • ether
  • oxetane
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • dialkyl ether
  • organoheterocyclic compound